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Discovery of a novel kinase hinge binder fragment by dynamic undocking

One of the key motifs of type I kinase inhibitors is their interactions with the hinge region of ATP binding sites. These interactions contribute significantly to the potency of the inhibitors; however, only a tiny fraction of the available chemical space has been explored with kinase inhibitors rep...

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Detalles Bibliográficos
Publicado en:RSC Med Chem
Main Authors: Rachman, Moira, Bajusz, Dávid, Hetényi, Anasztázia, Scarpino, Andrea, Merő, Balázs, Egyed, Attila, Buday, László, Barril, Xavier, Keserű, György M.
Formato: Artigo
Idioma:Inglês
Publicado: Royal Society of Chemistry 2020
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Acceso en liña:https://ncbi.nlm.nih.gov/pmc/articles/PMC7593776/
https://ncbi.nlm.nih.gov/pubmed/33479656
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1039/c9md00519f
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